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QuAcK/src/GW
History
Pierre-Francois Loos d2082f55f8 implementation of BSE2@GW
2022-11-28 15:05:29 +01:00
..
Bethe_Salpeter_A_matrix_dynamic.f90
BSE@GT potentially correct
2021-12-21 13:49:41 +01:00
Bethe_Salpeter_A_matrix.f90
regularized GW
2021-12-17 11:41:40 +01:00
Bethe_Salpeter_AB_matrix_dynamic.f90
remove print
2022-01-31 13:41:07 +01:00
Bethe_Salpeter_B_matrix.f90
regularized GW
2021-12-17 11:41:40 +01:00
Bethe_Salpeter_dynamic_perturbation_iterative.f90
fix bug in iterative dynamic correction
2022-08-15 09:49:57 +02:00
Bethe_Salpeter_dynamic_perturbation.f90
dynamic BSE@GT
2022-01-11 15:23:43 +01:00
Bethe_Salpeter_pp_so.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
Bethe_Salpeter_pp.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
Bethe_Salpeter_ZA_matrix_dynamic.f90
regularized GW
2021-12-17 11:41:40 +01:00
Bethe_Salpeter_ZAB_matrix_dynamic.f90
regularized GW
2021-12-17 11:41:40 +01:00
Bethe_Salpeter.f90
implementation of BSE2@GW
2022-11-28 15:05:29 +01:00
BSE_static_kernel_KA.f90
update eDFT module
2022-11-28 10:52:06 +01:00
BSE_static_kernel_KB.f90
update eDFT module
2022-11-28 10:52:06 +01:00
dSigmaC.f90
regularized GW
2021-12-17 11:41:40 +01:00
dUSigmaC.f90
regularized GW
2021-12-17 11:41:40 +01:00
evGW.f90
update eDFT module
2022-11-28 10:52:06 +01:00
evUGW.f90
problem with rcond in DIIS fixed
2022-01-06 22:36:30 +01:00
exchange_matrix_MO_basis.f90
regularized GW
2021-12-17 11:41:40 +01:00
excitation_density_SOSEX.f90
regularized GW
2021-12-17 11:41:40 +01:00
excitation_density.f90
regularized GW
2021-12-17 11:41:40 +01:00
G0W0_SOSEX.f90
clean up QuAcK
2022-11-08 15:38:46 +01:00
G0W0.f90
update eDFT module
2022-11-28 10:52:06 +01:00
plot_GW.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_evGW.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_evUGW.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_G0W0.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_qsGW.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_qsUGW.f90
problem with rcond in DIIS fixed
2022-01-06 22:36:30 +01:00
print_SOSEX.f90
regularized GW
2021-12-17 11:41:40 +01:00
print_UG0W0.f90
regularized GW
2021-12-17 11:41:40 +01:00
QP_graph.f90
regularized GW
2021-12-17 11:41:40 +01:00
QP_roots.f90
regularized GW
2021-12-17 11:41:40 +01:00
qsGW_PT.f90
regularized GW
2021-12-17 11:41:40 +01:00
qsGW.f90
update eDFT module
2022-11-28 10:52:06 +01:00
qsUGW.f90
problem with rcond in DIIS fixed
2022-01-06 22:36:30 +01:00
regularized_renormalization_factor.f90
fix bug
2021-12-17 15:42:16 +01:00
regularized_self_energy_correlation_diag.f90
regularized GW
2021-12-17 11:41:40 +01:00
regularized_self_energy_correlation.f90
regularized GW
2021-12-17 11:41:40 +01:00
renormalization_factor_so.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
renormalization_factor_SOSEX.f90
regularized GW
2021-12-17 11:41:40 +01:00
renormalization_factor.f90
regularized GW
2021-12-17 11:41:40 +01:00
self_energy_correlation_diag_so.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
self_energy_correlation_diag.f90
regularized GW
2021-12-17 11:41:40 +01:00
self_energy_correlation_SOSEX_diag.f90
regularized GW
2021-12-17 11:41:40 +01:00
self_energy_correlation.f90
GM in GT
2022-01-06 13:48:15 +01:00
self_energy_exchange_diag.f90
spinorbital BSE@G0T0
2022-01-26 13:05:16 +01:00
self_energy_exchange.f90
regularized GW
2021-12-17 11:41:40 +01:00
SigmaC.f90
regularized GW
2021-12-17 11:41:40 +01:00
soBSE.f90
adding routines for MBPT vs CC
2022-09-28 16:09:09 +02:00
soG0W0.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
static_screening_WA_so.f90
adding routines for MBPT vs CC
2022-09-28 16:09:09 +02:00
static_screening_WB_pp.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
static_screening_WB_so.f90
adding routines for MBPT vs CC
2022-09-28 16:09:09 +02:00
static_screening_WC_pp.f90
DIP- and DEA-EOM-CCD
2022-09-27 14:07:31 +02:00
static_screening_WD_pp.f90
working on ppBSE@GT
2022-09-09 21:48:50 +02:00
ufBSE.f90
regularized GW
2021-12-17 11:41:40 +01:00
ufG0W0.f90
changed cutoff in ufG0W0
2022-02-18 16:29:17 +01:00
ufGW.f90
regularized GW
2021-12-17 11:41:40 +01:00
UG0W0.f90
regularized self-energy in UGW
2022-01-06 22:10:53 +01:00
unrestricted_Bethe_Salpeter_A_matrix_dynamic.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_Bethe_Salpeter_A_matrix.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_Bethe_Salpeter_B_matrix.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_Bethe_Salpeter_dynamic_perturbation.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_Bethe_Salpeter_ZA_matrix_dynamic.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_Bethe_Salpeter.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_excitation_density.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_QP_graph.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_regularized_renormalization_factor.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_regularized_self_energy_correlation_diag.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_regularized_self_energy_correlation.f90
fix bug in regularized self energy
2022-01-06 22:13:45 +01:00
unrestricted_renormalization_factor.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_self_energy_correlation_diag.f90
regularized GW
2021-12-17 11:41:40 +01:00
unrestricted_self_energy_correlation.f90
regularized GW
2021-12-17 11:41:40 +01:00
USigmaC.f90
regularized GW
2021-12-17 11:41:40 +01:00